Exact Mass: 224.2252
Exact Mass Matches: 224.2252
Found 327 metabolites which its exact mass value is equals to given mass value 224.2252,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Cuscohygrine
Cuscohygrine is found in fruits. Cuscohygrine is an alkaloid from the root of Cyphomandra betacea (tree tomato) Cuscohygrine is a pyrrolidine alkaloid found in coca. It can be extracted from plants of the family Solanaceae as well, including Atropa belladonna (deadly nightshade), Datura inoxia and Datura stramonium (jimson weed). Cuscohygrine usually comes with other, more potent alkaloids like atropine or cocaine. Cuscohygrine is an oil, which can be distilled without decomposition only in vacuum. It is easily soluble in water and forms an optically inactive crystalline hydrate C13H24N2O-3H2O, which melts at 40-41°C Alkaloid from the root of Cyphomandra betacea (tree tomato)
Geranyl 2-methylpropanoate
Flavouring ingredient. Geranyl 2-methylpropanoate is found in wild carrot and carrot. Neryl isobutyrate is a flavouring ingredient.
3-Pentadecenal
3-Pentadecenal is found in green vegetables. 3-Pentadecenal is a constituent of the leaves of Viola odorata (sweet violet). Constituent of the leaves of Viola odorata (sweet violet). 3-Pentadecenal is found in tea and green vegetables.
Neryl butyrate
Geranyl butyrate is found in citrus. Geranyl butyrate is found in citrus peel oils, kumquat peel oil, celery leaves/stalks, tomato, yellow passion fruit, lavender oil and other essential oils. Geranyl butyrate is a flavouring agent. Found in citrus peel oils, kumquat peel oil, celery leaves/stalks, tomato, yellow passion fruit, lavender oil and other essential oils. Flavouring agent
Linalyl isobutyrate
Linalyl isobutyrate is found in herbs and spices. Linalyl isobutyrate is used in perfumery and food flavouring. Linalyl isobutyrate is found in lavender and Ceylon cinnamon oil It is used in perfumery and food flavouring. Found in lavender and Ceylon cinnamon oils.
Goshuyic acid
Goshuyic acid, also known as (Z,Z)-5,8-tetradecadienoic acid, is a member of the class of compounds known as long-chain fatty acids. Long-chain fatty acids are fatty acids with an aliphatic tail that contains between 13 and 21 carbon atoms. Goshuyic acid is practically insoluble (in water) and a weakly acidic compound (based on its pKa). Within the cell, goshuyic acid is primarily located in the membrane (predicted from logP). It can also be found in the extracellular space. Goshuyic acid is an intermediate of unsaturated fatty acid oxidation. An increase of goshuyic acid in plasma is associated with acyl-CoA dehydrogenase deficiency disorders (PMID: 7586519). Goshuyic acid is found in fats and oils and is a minor constituent of rape oil. Minor constituent of rape oil. (Z,Z)-5,8-Tetradecadienoic acid is found in fats and oils.
(+/-)-Dihydrofarnesol
(+/-)-Dihydrofarnesol is used as a food additive [EAFUS] ("EAFUS: Everything Added to Food in the United States. [http://www.eafus.com/]") It is used as a food additive .
Linalyl butyrate
Linalyl butyrate is found in fruits. Linalyl butyrate is used in perfumery and food flavouring. Linalyl butyrate is present in oils of kumquat peel, lavender and Artemesia porrecta var. coerule Linalyl butyrate is used in perfumery and food flavouring. Present in oils of kumquat peel, lavender and Artemesia porrecta var. coerulea. It is also found in herbs and spices and fruits.
Ethyl (2E,6Z)-dodecadienoate
Ethyl (2E,6Z)-dodecadienoate is found in pomes. Ethyl (2E,6Z)-dodecadienoate is a constituent of Bartlett pears Constituent of Bartlett pears. Ethyl (2E,6Z)-dodecadienoate is found in pomes.
5,10-Pentadecadien-1-ol
5,10-Pentadecadien-1-ol is found in green vegetables. 5,10-Pentadecadien-1-ol is a flavouring ingredient. 5,10-Pentadecadien-1-ol is a constituent of the flowers of sweet violet (Viola odorata Flavouring ingredient. Constituent of the flowers of sweet violet (Viola odorata). 5,10-Pentadecadien-1-ol is found in tea and green vegetables.
alpha-Terpineol butanoate
alpha-Terpineol butanoate is a flavouring agent Flavouring agent
Isobornyl isobutyrate
Isobornyl isobutyrate is used as a food additive [EAFUS] ("EAFUS: Everything Added to Food in the United States. [http://www.eafus.com/]") It is used as a food additive .
Terpinyl isobutyrate
alpha-Terpinyl isobutyrate is a flavouring ingredient with a heavy, fruity-type flavour. It is used as a food additive .
Allyl undecylenate
Allyl 10-undecenotate is a flavouring ingredient with a fruity odour suggestive of pineapple. Flavouring ingredient with a fruity odour suggestive of pineapple
2-Propenyl cyclohexanepentanoate
2-Propenyl cyclohexanepentanoate is a flavouring ingredient. Flavouring ingredient
Bornyl butyrate
Bornyl butyrate is a flavouring agent. Flavouring agent
(2R,5S,8R)-2,8-Dimethyl-5-propan-2-ylcyclodecan-1-one
Lavandulyl butyrate
Lavandulyl butyrate is a member of the class of compounds known as acyclic monoterpenoids. Acyclic monoterpenoids are monoterpenes that do not contain a cycle. Lavandulyl butyrate is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Lavandulyl butyrate can be found in spearmint, which makes lavandulyl butyrate a potential biomarker for the consumption of this food product.
(2E,4E,6S)-4,6-Dimethyl-2,4-dodecadienoic acid|(2E,4E,6S)-4,6-Dimethyldodeca-2,4-dienoic acid|(6S)-4,6-dimethyl-2E,4E-dienoic acid|6-(S)-4,6-dimethyldodecadienoic acid
(all-Z)-7-Methyl-3-propyl-2,6-decadien-1-ol|7-Methyl-3-propyl-2,6-decadien-1-ol
(+)-austrodoric acid|(5S,8R,10S)-austrodoric acid|(9S)-austrodoric acid|austrodoric acid
(+)-8alpha-Hydroxy-11-driman-9-on|11-Nor-8-hydroxy-9-drimanon|11-nor-8-hydroxy-9-drimanone|2-hydroxy-2,5,5,9-tetramethyl-1-decalone|8alpha-hydroxy-11-nordriman-9-one
2-Propanone, 1-(1,1-dimethyl[2,3-bipyrrolidin]-5-yl)-
dicyclohexylurea
The sample was injected by direct infusion.; This record was created by the financial support of MEXT/JSPS KAKENHI Grant Number 19HP8024 to the Mass Spectrometry Society of Japan.
4-methyl-N-[2-(4-methylpentan-2-ylideneamino)ethyl]pentan-2-imine
4-(1-ethoxyvinyl)-3,3,5,5-tetramethylcyclohexanone
4,4,5,5-Tetramethyl-2-[2-(2-methyl-2-propanyl)cyclopropyl]-1,3,2-dioxaborolane
1,3,3-Trimethylbicyclo[2.2.1]hept-2-yl 2-methylpropanoate
(-)-Anaferine
A piperidine alkaloid that is piperidine substituted by a 2-oxo-3-[(2R)-piperidin-2-yl]propyl group at position 2.
(2R,5S,8R)-2,8-Dimethyl-5-propan-2-ylcyclodecan-1-one
4-(1-Methyl-1-pyrrolidin-1-iumyl)-9-bicyclo[3.3.1]nonanol
2-[(1R)-4-methylcyclohex-3-en-1-yl]propan-2-yl butanoate
cis,cis-Tetradeca-5,8-dienoic acid
A straight-chain, diunsaturated, 14-carbon long-chain fatty acid with cis-double bonds at positions C-5 and C-8.
(3E,5Z)-tetradecadienoic acid
A long-chain polyunsaturated fatty acid that is tetredecanoic acid containing two double bonds at positions 3 and 5 (the 3E,5Z-geoisomer).
(1r,4r,6r,9r,10s)-4,12,12-trimethyl-5-oxatricyclo[8.2.0.0⁴,⁶]dodecan-9-ol
(5r,6s,7e,9e)-6-hydroxy-5,7,9-trimethylundeca-7,9-dien-4-one
(4r,5r)-2,5-diethyl-4-hydroxy-5-methyl-3-(sec-butyl)cyclopent-2-en-1-one
2-[(2r,4ar,8s,8ar)-4a,8-dimethyl-octahydro-1h-naphthalen-2-yl]propan-2-ol
7-(hydroxymethyl)-4-isopropyl-1,8-dimethylbicyclo[3.2.1]octan-6-one
(2r)-2-[(1s,4r)-4-hydroxy-4-methylcyclohex-2-en-1-yl]heptan-4-one
(1s,3s,5s,7s,9s,11s)-3,7,11-trimethyl-2,6,10,13-tetraazatricyclo[7.3.1.0⁵,¹³]tridecane
1,4,4,7a-tetramethyl-hexahydroindene-1-carboxylic acid
1-Hexadecene 1-
{"Ingredient_id": "HBIN002581","Ingredient_name": "1-Hexadecene 1-","Alias": "NA","Ingredient_formula": "C16H32","Ingredient_Smile": "CCCCCCCCCCCCCCC=C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "37340","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2,3-dihydro-farnesol
{"Ingredient_id": "HBIN004020","Ingredient_name": "2,3-dihydro-farnesol","Alias": "NA","Ingredient_formula": "C15H28O","Ingredient_Smile": "CC(CCC=C(C)CCC=C(C)C)CCO","Ingredient_weight": "224.38 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "8947","PubChem_id": "15584898","DrugBank_id": "NA"}
3-Hexadecene
{"Ingredient_id": "HBIN008581","Ingredient_name": "3-Hexadecene","Alias": "NA","Ingredient_formula": "C16H32","Ingredient_Smile": "CCCCCCCCCCCCC=CCC","Ingredient_weight": "224.42 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "36215","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "5352251","DrugBank_id": "NA"}
3-Hexadecene,(Z)-
{"Ingredient_id": "HBIN008582","Ingredient_name": "3-Hexadecene,(Z)-","Alias": "NA","Ingredient_formula": "C16H32","Ingredient_Smile": "CCCCCCCCCCCCC=CCC","Ingredient_weight": "224.42 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "40992","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "5364494","DrugBank_id": "NA"}
(3 trans)- hexadecene
{"Ingredient_id": "HBIN009749","Ingredient_name": "(3 trans)- hexadecene","Alias": "NA","Ingredient_formula": "C16H32","Ingredient_Smile": "CCCCCCCCCCCCC=CCC","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "33892","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
7-Hexadecene
{"Ingredient_id": "HBIN013194","Ingredient_name": "7-Hexadecene","Alias": "NA","Ingredient_formula": "C16H32","Ingredient_Smile": "CCCCCCCCC=CCCCCCC","Ingredient_weight": "224.42 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "36216","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "5352264","DrugBank_id": "NA"}
artemisinol
{"Ingredient_id": "HBIN016963","Ingredient_name": "artemisinol","Alias": "AC1NSZG5; 2-(4,7-dimethyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)propan-1-ol","Ingredient_formula": "C15H28O","Ingredient_Smile": "CC1CCC2C(CCC(C2C1)C(C)CO)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT01277","TCMID_id": "1799","TCMSP_id": "NA","TCM_ID_id": "6607","PubChem_id": "NA","DrugBank_id": "NA"}
